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Home > Boronic Acids > 1510828-68-8
1510828-68-8 | 2-Fluoro-4-methyl-5-nitrophenylboronic acid, pinacol ester
CAS No: 1510828-68-8 Catalog No: AG00HXUD MDL No:MFCD22586691
Product Description
Catalog Number:
AG00HXUD
Chemical Name:
2-Fluoro-4-methyl-5-nitrophenylboronic acid, pinacol ester
CAS Number:
1510828-68-8
Molecular Formula:
C13H17BFNO4
Molecular Weight:
281.0878
MDL Number:
MFCD22586691
IUPAC Name:
2-(2-fluoro-4-methyl-5-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H17BFNO4/c1-8-6-10(15)9(7-11(8)16(17)18)14-19-12(2,3)13(4,5)20-14/h6-7H,1-5H3
InChI Key:
VJFYRTJYOVWHNP-UHFFFAOYSA-N
SMILES:
Fc1cc(C)c(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.123g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.09g/mol
Monoisotopic Mass:
281.123g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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